============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. PHE 6 1.000 20.096 53.435 16.724 -99.200 -91.000 TYR 7 0.840 16.823 54.983 20.076 -99.200 -91.000 PHE 26 1.000 -5.430 49.810 26.952 -99.200 -91.000 HIS 40 0.900 4.701 50.716 13.213 -99.200 -91.000 PHE 41 1.000 -1.980 49.554 7.113 -99.200 -91.000 HIS 42 0.900 -3.711 54.681 7.799 -99.200 -91.000 PHE 45 1.000 0.971 49.047 3.494 -99.200 -91.000 PHE 77 1.000 -2.407 62.200 14.513 -99.200 -91.000 PHE 103 1.000 11.180 51.831 20.394 -99.200 -91.000 TYR 117 0.840 5.582 43.407 18.302 -99.200 -91.000 PHE 143 1.000 -7.758 48.931 -3.052 -99.200 -91.000 PHE 152 1.000 -1.395 44.764 3.461 -99.200 -91.000 HIS 169 0.900 -9.248 45.986 9.811 -99.200 -91.000 HIS 175 0.900 -14.853 57.668 11.691 -99.200 -91.000 PHE 179 1.000 -19.822 50.208 8.811 -99.200 -91.000 TYR 184 0.840 -28.134 52.674 4.104 -99.200 -91.000 PHE 186 1.000 -23.070 44.721 -2.686 -99.200 -91.000 TYR 200 0.840 -22.385 43.184 12.088 -99.200 -91.000 PHE 215 1.000 -14.371 65.630 7.330 -99.200 -91.000 TYR 234 0.840 -10.445 40.541 10.857 -99.200 -91.000 TYR 235 0.840 -7.624 36.435 11.456 -99.200 -91.000 TRP 271 1.040 -3.699 36.556 14.127 -99.200 -91.000 TRP6 271 1.020 -4.086 37.927 16.009 -99.200 -91.000 PHE 275 1.000 -1.040 41.994 14.898 -99.200 -91.000